1-methyl-4-phenyl-azepane-4-carboxylic acid

Systemtic Name: 1-methyl-4-phenyl-azepane-4-carboxylic acid Openeye Name: 1-methyl-4-phenyl-azepane-4-carboxylic acid CAS Name: 1-methyl-4-phenyl-4-azepanecarboxylic acid IUPAC Name: 1-methyl-4-phenylazepane-4-carboxylic acid Traditional Name: 1-methyl-4-phenyl-azepane-4-carboxylic acid Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(CC1)(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN1CCCC(CC1)(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H19NO2/c1-15-10-5-8-14(9-11-15,13(16)17)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,16,17)